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Thiazolo[4,5-d]pyrimidine-2(3H)-thione, 7-(1,3-benzothiazol-2-ylthio)-5-methyl-3-(phenylmethyl)-
SpectraBase Compound ID JEecyNtuEU2
InChI InChI=1S/C20H14N4S4/c1-12-21-17-16(27-20(25)24(17)11-13-7-3-2-4-8-13)18(22-12)28-19-23-14-9-5-6-10-15(14)26-19/h2-10H,11H2,1H3
InChIKey DKNUBFYPNFTOJG-UHFFFAOYSA-N
Mol Weight 438.6 g/mol
Molecular Formula C20H14N4S4
Exact Mass 438.010131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ESLFGJ5axfV
Name Thiazolo[4,5-d]pyrimidine-2(3H)-thione, 7-(1,3-benzothiazol-2-ylthio)-5-methyl-3-(phenylmethyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H14N4S4
InChI InChI=1S/C20H14N4S4/c1-12-21-17-16(27-20(25)24(17)11-13-7-3-2-4-8-13)18(22-12)28-19-23-14-9-5-6-10-15(14)26-19/h2-10H,11H2,1H3
InChIKey DKNUBFYPNFTOJG-UHFFFAOYSA-N
Molecular Weight 438.600 g/mol
SMILES c12c(c(nc(n2)C)Sc2sc3ccccc3n2)SC(N1Cc1ccccc1)=S
SPLASH splash10-000l-9324800000-30db178eb94d764b2151
Source of Spectrum IY-1-4591-7
Synonyms 7-(1,3-benzothiazol-2-ylthio)-5-methyl-3-(phenylmethyl)-2-thiazolo[4,5-d]pyrimidinethione 7-(1,3-benzothiazol-2-ylsulfanyl)-3-benzyl-5-methyl-[1,3]thiazolo[4,5-d]pyrimidine-2-thione 7-(1,3-benzothiazol-2-ylsulfanyl)-3-benzyl-5-methyl-thiazolo[4,5-d]pyrimidine-2-thione 7-(1,3-benzothiazol-2-ylsulfanyl)-5-methyl-3-(phenylmethyl)-[1,3]thiazolo[4,5-d]pyrimidine-2-thione
Wiley ID 1653900